SCHEMBL11005771

SCHEMBL11005771

CN1Cc2sc(CO)cc2C(c2ccc(Cl)cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.50
SLC6A2 P23975 9/20 0.50
SLC6A3 Q01959 9/20 0.50
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
HRH3 Q9Y5N1 2/20 0.40
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
CYP2D6 P10635 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11003203 0.89 SLC6A4 (0.52) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11001890 0.88 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11003392 0.88 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11005340 0.85 SLC6A4 (0.47) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL11000635 0.85 SLC6A4 (0.48) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11006639 0.84 NPC1 (0.65) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11169584 0.83 SLC6A4 (0.48) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11005099 0.83 SLC6A4 (0.46) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11216783 0.83 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3NPC1RAB9A
SCHEMBL11001849 0.82 SLC6A4 (0.46) SLC6A4SLC6A2SLC6A3NPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4550106-A ANTIDEPRESSANTS BOEHRINGER INGELHEIM KG (DE) 1985-10-29 US disclosed
US-4482559-A ANTIDEPRESSANT BOEHRINGER INGELHEIM KG (DE) 1984-11-13 US disclosed
EP-0088250-A2 Basic substituted 4-phenyl-4,5,6,7-tetrahydrothieno(2,3-c) pyridines, process for their preparation and pharmaceutical compositions containing them BOEHRINGER INGELHEIM KG (DE) 1983-09-14 EP disclosed